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	hartrees
Energy at 0K	-188.475354
Energy at 298.15K	-188.478103
HF Energy	-188.127569
Nuclear repulsion energy	71.433593

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3395	3290	5.37
2	A	3261	3161	8.13
3	A	3123	3027	6.43
4	A	1463	1418	4.94
5	A	1314	1274	58.90
6	A	1154	1119	12.10
7	A	1072	1039	18.97
8	A	855	828	4.15
9	A	738	716	38.11
10	A	438	424	5.28
11	A	155	150	18.38
12	A	111	108	164.98

Atom	x (Å)	y (Å)	z (Å)
C1	1.187	0.275	0.114
O2	0.085	-0.611	-0.073
O3	-1.158	0.307	-0.050
H4	1.050	1.300	-0.216
H5	2.129	-0.250	-0.031
H6	-1.722	-0.270	0.544

	C1	O2	O3	H4	H5	H6
C1		1.4272	2.3510	1.0856	1.0877	2.9910
O2	1.4272		1.5453	2.1465	2.0760	1.9395
O3	2.3510	1.5453		2.4267	3.3333	1.0021
H4	1.0856	2.1465	2.4267		1.8976	3.2754
H5	1.0877	2.0760	3.3333	1.8976		3.8934
H6	2.9910	1.9395	1.0021	3.2754	3.8934

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O2	O3	104.475	O2	C1	H4	116.701
O2	C1	H5	110.552	O2	O3	H6	96.849
H4	C1	H5	121.649

All results from a given calculation for CH₂OOH (CH2OOH radical)

using model chemistry: QCISD/3-21G

States and conformations

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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All results from a given calculation for CH2OOH (CH2OOH radical)

using model chemistry: QCISD/3-21G

States and conformations

All results from a given calculation for CH₂OOH (CH2OOH radical)